Recent Advances in QSAR Studies : Methods and Applications /
| Autor Corporativo: | |
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| Otros Autores: | , , |
| Formato: | eBook |
| Lenguaje: | English |
| Publicado: |
Dordrecht :
Springer Netherlands : Imprint: Springer,
2010.
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| Edición: | 1st ed. 2010. |
| Colección: | Challenges and Advances in Computational Chemistry and Physics,
8 |
| Materias: |
Tabla de Contenidos:
- Theory of QSAR
- Quantitative Structure–Activity Relationships (QSARs) – Applications and Methodology
- The Use of Quantum Mechanics Derived Descriptors in Computational Toxicology
- Molecular Descriptors
- 3D-QSAR – Applications, Recent Advances, and Limitations
- Virtual Screening and Molecular Design Based on Hierarchical Qsar Technology
- Robust Methods in Qsar
- Chemical Category Formation and Read-Across for the Prediction of Toxicity
- Practical Application
- QSAR in Chromatography: Quantitative Structure–Retention Relationships (QSRRs)
- The Use of Qsar and Computational Methods in Drug Design
- In Silico Approaches for Predicting Adme Properties
- Prediction of Harmful Human Health Effects of Chemicals from Structure
- Chemometric Methods and Theoretical Molecular Descriptors in Predictive QSAR Modeling of the Environmental Behavior of Organic Pollutants
- The Role of Qsar Methodology in the Regulatory Assessment of Chemicals
- Nanomaterials – the Next Great Challenge for Qsar Modelers.